6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide

C17H19N3O2 — CID 154835453

IUPAC6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide
SMILESCc1ccc2nc(C(=O)NC3C(=O)NCCC3C)ccc2c1
InChIInChI=1S/C17H19N3O2/c1-10-3-5-13-12(9-10)4-6-14(19-13)16(21)20-15-11(2)7-8-18-17(15)22/h3-6,9,11,15H,7-8H2,1-2H3,(H,18,22)(H,20,21)
InChIKeyHMTRQGKEDAQTMJ-UHFFFAOYSA-N
MW297.36 g/mol
LogP1.80
Rot. Bonds2

About 6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide

6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide (PubChem CID 154835453) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide.

Molecular Properties

Compound Name6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide
PubChem CID154835453
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide
SMILESCc1ccc2nc(C(=O)NC3C(=O)NCCC3C)ccc2c1
InChIInChI=1S/C17H19N3O2/c1-10-3-5-13-12(9-10)4-6-14(19-13)16(21)20-15-11(2)7-8-18-17(15)22/h3-6,9,11,15H,7-8H2,1-2H3,(H,18,22)(H,20,21)
InChIKeyHMTRQGKEDAQTMJ-UHFFFAOYSA-N
XLogP1.80
TPSA71.09 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 51.80
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide?
The IUPAC name of 6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide (CID 154835453) is 6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide.
What is the SMILES notation for 6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide?
The canonical SMILES for 6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide is Cc1ccc2nc(C(=O)NC3C(=O)NCCC3C)ccc2c1.
What is the InChIKey of 6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide?
The InChIKey is HMTRQGKEDAQTMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-10-3-5-13-12(9-10)4-6-14(19-13)16(21)20-15-11(2)7-8-18-17(15)22/h3-6,9,11,15H,7-8H2,1-2H3,(H,18,22)(H,20,21).
What are the key properties of 6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide?
6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide has a molecular weight of 297.36 g/mol, XLogP of 1.80, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(4-methyl-2-oxopiperidin-3-yl)quinoline-2-carboxamide is sourced from PubChem (CID 154835453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).